A Fourier method solution for the time dependent Schrödinger equation: A study of the reaction H++H2, D++HD, and D++H2
✍ Scribed by Kosloff, R.; Kosloff, D.
- Book ID
- 121661482
- Publisher
- American Institute of Physics
- Year
- 1983
- Tongue
- English
- Weight
- 846 KB
- Volume
- 79
- Category
- Article
- ISSN
- 0021-9606
- DOI
- 10.1063/1.445959
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📜 SIMILAR VOLUMES
The rate wfficients k for the nearly thermoneulral atom abstracbon reactions of N+ ions \nth H,. HD and D, have befn dct-cd as a ~uncrion of ion-molecule cenue-or-mars energy. KE, in a SLFDT apparatus. over tic range of KE, Zrom thermal energy at 300 K to = 0 5 eV. From Arrhenius-type plots OF In k
scattering matrix elements for the collinear reaction H + H2 ( u) -'Ha ( v') + H are computed using a new time-dependent method based on the Msller operator formulation of scattering theory. Reaction dynamics are determined by the LSTH potential energy surface where attention is focused on two asymp